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Title: Materials Data on Mn5C2 by Materials Project

Abstract

Mn5C2 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. there are three inequivalent Mn sites. In the first Mn site, Mn is bonded in a 2-coordinate geometry to three equivalent C atoms. There are two shorter (1.97 Å) and one longer (2.23 Å) Mn–C bond lengths. In the second Mn site, Mn is bonded to four equivalent C atoms to form distorted edge-sharing MnC4 tetrahedra. There are two shorter (2.01 Å) and two longer (2.03 Å) Mn–C bond lengths. In the third Mn site, Mn is bonded in a bent 150 degrees geometry to two equivalent C atoms. There is one shorter (1.98 Å) and one longer (2.01 Å) Mn–C bond length. C is bonded in a 7-coordinate geometry to seven Mn atoms.

Publication Date:
Other Number(s):
mp-22749
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Mn5C2; C-Mn
OSTI Identifier:
1198945
DOI:
10.17188/1198945

Citation Formats

The Materials Project. Materials Data on Mn5C2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1198945.
The Materials Project. Materials Data on Mn5C2 by Materials Project. United States. doi:10.17188/1198945.
The Materials Project. 2020. "Materials Data on Mn5C2 by Materials Project". United States. doi:10.17188/1198945. https://www.osti.gov/servlets/purl/1198945. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1198945,
title = {Materials Data on Mn5C2 by Materials Project},
author = {The Materials Project},
abstractNote = {Mn5C2 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. there are three inequivalent Mn sites. In the first Mn site, Mn is bonded in a 2-coordinate geometry to three equivalent C atoms. There are two shorter (1.97 Å) and one longer (2.23 Å) Mn–C bond lengths. In the second Mn site, Mn is bonded to four equivalent C atoms to form distorted edge-sharing MnC4 tetrahedra. There are two shorter (2.01 Å) and two longer (2.03 Å) Mn–C bond lengths. In the third Mn site, Mn is bonded in a bent 150 degrees geometry to two equivalent C atoms. There is one shorter (1.98 Å) and one longer (2.01 Å) Mn–C bond length. C is bonded in a 7-coordinate geometry to seven Mn atoms.},
doi = {10.17188/1198945},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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